MacSPARTAN '08 MECHANICS PROGRAM: x86/Darwin       131


 Frequency Calculation

  Adjusted 104 (out of 234) low frequency modes

  Reason for exit: Successful completion 
  Mechanics CPU Time :          .27
  Mechanics Wall Time:         5.35

MacSPARTAN '08 Quantum Mechanics Program:  (x86/Darwin)     build  131v4

Job type: Geometry optimization.
Method: RB3LYP
Basis set: 6-31G(D)
Number of shells: 250
Number of basis functions: 762
Multiplicity: 1

SCF model:
 A restricted hybrid HF-DFT SCF calculation will be
 performed using Pulay DIIS + Geometric Direct Minimization


Optimization:
         Step      Energy          Max Grad.      Max Dist. 
            1    -2378.658673       0.116576       0.081385
            2    -2378.661803       0.072936       0.094616
            3    -2378.668146       0.022853       0.075134
            4    -2378.666739       0.019561       0.071997
            5    -2378.667533       0.022259       0.074918

  Reason for exit: User Terminated Program 
  Quantum Calculation CPU Time :   2:43:46.74
  Quantum Calculation Wall Time:  22:15:45.87

sp_qchem (9613) returned error status of 57
Task "Q-CHEM" returned [57]



End-   molecule "M0001" Thu Feb  9 18:58:48 2012